ChemSpider 2D Image | 2,4-Dideoxy-2-octylpentaric acid | C13H24O5

2,4-Dideoxy-2-octylpentaric acid

  • Molecular FormulaC13H24O5
  • Average mass260.327 Da
  • Monoisotopic mass260.162384 Da
  • ChemSpider ID22369692

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2,4-Dideoxy-2-octylpentaric acid [ACD/IUPAC Name]
2,4-Didesoxy-2-octylpentarsäure [German] [ACD/IUPAC Name]
Acide 2,4-didésoxy-2-octylpentarique [French] [ACD/IUPAC Name]
Pentaric acid, 2,4-dideoxy-2-octyl- [ACD/Index Name]
3-Hydroxy-2-octylpentanedioic acid
913691-37-9 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 422.4±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.1±6.0 kJ/mol
Flash Point: 223.4±22.4 °C
Index of Refraction: 1.492
Molar Refractivity: 66.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 1.38
ACD/LogD (pH 5.5): -0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.57
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 95 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 47.2±3.0 dyne/cm
Molar Volume: 230.6±3.0 cm3

Click to predict properties on the Chemicalize site


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